11A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAD | sing | 1.53Å | 1.51Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| CAD | CAE | sing | 1.53Å | 1.53Å | |
| CAD | HAD1 | sing | 1.09Å | 1.10Å | |
| CAD | HAD2 | sing | 1.09Å | 1.10Å | |
| CAE | CAF | sing | 1.53Å | 1.53Å | |
| CAE | HAE1 | sing | 1.09Å | 1.10Å | |
| CAE | HAE2 | sing | 1.09Å | 1.10Å | |
| CAF | CAG | sing | 1.53Å | 1.53Å | |
| CAF | HAF1 | sing | 1.09Å | 1.10Å | |
| CAF | HAF2 | sing | 1.09Å | 1.10Å | |
| CAG | CAH | sing | 1.53Å | 1.52Å | |
| CAG | HAG1 | sing | 1.09Å | 1.10Å | |
| CAG | HAG2 | sing | 1.09Å | 1.10Å | |
| CAH | CAI | sing | 1.53Å | 1.53Å | |
| CAH | HAH1 | sing | 1.09Å | 1.10Å | |
| CAH | HAH2 | sing | 1.09Å | 1.10Å | |
| CAI | CAJ | sing | 1.53Å | 1.50Å | |
| CAI | HAI1 | sing | 1.09Å | 1.10Å | |
| CAI | HAI2 | sing | 1.09Å | 1.10Å | |
| CAJ | CAK | sing | 1.53Å | 1.53Å | |
| CAJ | HAJ1 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ2 | sing | 1.09Å | 1.10Å | |
| CAK | CAL | sing | 1.53Å | 1.51Å | |
| CAK | HAK1 | sing | 1.09Å | 1.10Å | |
| CAK | HAK2 | sing | 1.09Å | 1.10Å | |
| CAL | CAM | sing | 1.51Å | 1.53Å | |
| CAL | HAL1 | sing | 1.09Å | 1.10Å | |
| CAL | HAL2 | sing | 1.09Å | 1.10Å | |
| CAM | OAC | sing | 1.34Å | 1.21Å | |
| CAM | OAB | doub | 1.21Å | 1.22Å | |
| OAC | HAC | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAD | CAA | HAA1 | 109.5° | 109.5° |
| CAD | CAA | HAA2 | 109.5° | 109.5° |
| CAD | CAA | HAA3 | 109.5° | 109.5° |
| CAA | CAD | CAE | 110.3° | 109.5° |
| CAA | CAD | HAD1 | 109.0° | 109.5° |
| CAA | CAD | HAD2 | 109.2° | 109.4° |
| HAA1 | CAA | HAA2 | 109.5° | 109.5° |
| HAA1 | CAA | HAA3 | 109.4° | 109.4° |
| HAA2 | CAA | HAA3 | 109.4° | 109.4° |
| CAE | CAD | HAD1 | 109.0° | 109.5° |
| CAE | CAD | HAD2 | 109.2° | 109.5° |
| CAD | CAE | CAF | 109.9° | 109.5° |
| CAD | CAE | HAE1 | 109.2° | 109.5° |
| CAD | CAE | HAE2 | 109.3° | 109.5° |
| HAD1 | CAD | HAD2 | 110.1° | 109.5° |
| CAF | CAE | HAE1 | 109.2° | 109.5° |
| CAF | CAE | HAE2 | 109.3° | 109.4° |
| CAE | CAF | CAG | 112.2° | 109.5° |
| CAE | CAF | HAF1 | 107.9° | 109.5° |
| CAE | CAF | HAF2 | 108.6° | 109.4° |
| HAE1 | CAE | HAE2 | 109.8° | 109.4° |
| CAG | CAF | HAF1 | 108.0° | 109.5° |
| CAG | CAF | HAF2 | 108.6° | 109.4° |
| CAF | CAG | CAH | 110.5° | 109.5° |
| CAF | CAG | HAG1 | 108.9° | 109.5° |
| CAF | CAG | HAG2 | 109.2° | 109.4° |
| HAF1 | CAF | HAF2 | 111.6° | 109.5° |
| CAH | CAG | HAG1 | 108.9° | 109.5° |
| CAH | CAG | HAG2 | 109.2° | 109.5° |
| CAG | CAH | CAI | 108.6° | 109.5° |
| CAG | CAH | HAH1 | 109.9° | 109.5° |
| CAG | CAH | HAH2 | 109.8° | 109.4° |
| HAG1 | CAG | HAG2 | 110.2° | 109.4° |
| CAI | CAH | HAH1 | 109.9° | 109.5° |
| CAI | CAH | HAH2 | 109.8° | 109.5° |
| CAH | CAI | CAJ | 112.3° | 109.5° |
| CAH | CAI | HAI1 | 107.9° | 109.5° |
| CAH | CAI | HAI2 | 108.5° | 109.5° |
| HAH1 | CAH | HAH2 | 108.8° | 109.4° |
| CAJ | CAI | HAI1 | 107.9° | 109.5° |
| CAJ | CAI | HAI2 | 108.6° | 109.4° |
| CAI | CAJ | CAK | 109.9° | 109.5° |
| CAI | CAJ | HAJ1 | 109.2° | 109.5° |
| CAI | CAJ | HAJ2 | 109.3° | 109.4° |
| HAI1 | CAI | HAI2 | 111.7° | 109.5° |
| CAK | CAJ | HAJ1 | 109.2° | 109.5° |
| CAK | CAJ | HAJ2 | 109.3° | 109.5° |
| CAJ | CAK | CAL | 112.5° | 109.5° |
| CAJ | CAK | HAK1 | 107.7° | 109.5° |
| CAJ | CAK | HAK2 | 108.5° | 109.4° |
| HAJ1 | CAJ | HAJ2 | 109.8° | 109.4° |
| CAL | CAK | HAK1 | 107.8° | 109.5° |
| CAL | CAK | HAK2 | 108.4° | 109.5° |
| CAK | CAL | CAM | 113.2° | 109.5° |
| CAK | CAL | HAL1 | 107.4° | 109.5° |
| CAK | CAL | HAL2 | 108.2° | 109.4° |
| HAK1 | CAK | HAK2 | 111.9° | 109.5° |
| CAM | CAL | HAL1 | 107.4° | 109.5° |
| CAM | CAL | HAL2 | 108.2° | 109.5° |
| CAL | CAM | OAC | 120.0° | 120.0° |
| CAL | CAM | OAB | 122.1° | 120.0° |
| HAL1 | CAL | HAL2 | 112.4° | 109.4° |
| OAC | CAM | OAB | 117.9° | 120.0° |
| CAM | OAC | HAC | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAD | CAA | HAA1 | HAA2 | 120.0° | 120.1° |
| CAD | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
| CAD | CAA | HAA2 | HAA3 | 120.1° | 120.0° |
| CAA | CAD | CAE | HAD1 | 119.6° | 120.0° |
| CAA | CAD | CAE | HAD2 | 120.0° | 119.9° |
| CAA | CAD | HAD1 | HAD2 | 119.8° | 120.0° |
| CAA | CAD | CAE | CAF | 178.5° | 180.0° |
| CAA | CAD | CAE | HAE1 | 61.7° | 59.9° |
| CAA | CAD | CAE | HAE2 | 58.5° | 60.0° |
| HAA1 | CAA | HAA2 | HAA3 | 119.9° | 119.9° |
| HAA1 | CAA | CAD | CAE | 37.3° | 60.0° |
| HAA1 | CAA | CAD | HAD1 | 82.3° | 180.0° |
| HAA1 | CAA | CAD | HAD2 | 157.4° | 60.0° |
| HAA2 | CAA | CAD | CAE | 82.7° | 180.0° |
| HAA2 | CAA | CAD | HAD1 | 157.7° | 60.0° |
| HAA2 | CAA | CAD | HAD2 | 37.4° | 60.1° |
| HAA3 | CAA | CAD | CAE | 157.3° | 60.0° |
| HAA3 | CAA | CAD | HAD1 | 37.7° | 60.0° |
| HAA3 | CAA | CAD | HAD2 | 82.7° | 180.0° |
| CAE | CAD | HAD1 | HAD2 | 119.8° | 120.0° |
| CAD | CAE | CAF | HAE1 | 119.8° | 120.1° |
| CAD | CAE | CAF | HAE2 | 120.0° | 120.0° |
| CAD | CAE | HAE1 | HAE2 | 119.9° | 120.0° |
| CAD | CAE | CAF | CAG | 4.9° | 180.0° |
| CAD | CAE | CAF | HAF1 | 123.8° | 60.0° |
| CAD | CAE | CAF | HAF2 | 115.1° | 60.1° |
| HAD1 | CAD | CAE | CAF | 58.9° | 60.0° |
| HAD1 | CAD | CAE | HAE1 | 178.7° | 180.0° |
| HAD1 | CAD | CAE | HAE2 | 61.1° | 60.0° |
| HAD2 | CAD | CAE | CAF | 61.4° | 60.1° |
| HAD2 | CAD | CAE | HAE1 | 58.4° | 60.0° |
| HAD2 | CAD | CAE | HAE2 | 178.5° | 180.0° |
| CAF | CAE | HAE1 | HAE2 | 119.9° | 119.9° |
| CAE | CAF | CAG | HAF1 | 118.8° | 120.0° |
| CAE | CAF | CAG | HAF2 | 120.0° | 119.9° |
| CAE | CAF | HAF1 | HAF2 | 119.2° | 120.0° |
| CAE | CAF | CAG | CAH | 165.1° | 180.0° |
| CAE | CAF | CAG | HAG1 | 45.5° | 59.9° |
| CAE | CAF | CAG | HAG2 | 74.9° | 60.0° |
| HAE1 | CAE | CAF | CAG | 114.9° | 59.9° |
| HAE1 | CAE | CAF | HAF1 | 4.0° | 180.0° |
| HAE1 | CAE | CAF | HAF2 | 125.1° | 60.0° |
| HAE2 | CAE | CAF | CAG | 124.9° | 60.0° |
| HAE2 | CAE | CAF | HAF1 | 116.2° | 60.0° |
| HAE2 | CAE | CAF | HAF2 | 4.9° | 180.0° |
| CAG | CAF | HAF1 | HAF2 | 119.3° | 120.0° |
| CAF | CAG | CAH | HAG1 | 119.6° | 120.0° |
| CAF | CAG | CAH | HAG2 | 120.0° | 120.0° |
| CAF | CAG | HAG1 | HAG2 | 119.7° | 119.9° |
| CAF | CAG | CAH | CAI | 168.5° | 180.0° |
| CAF | CAG | CAH | HAH1 | 48.2° | 59.9° |
| CAF | CAG | CAH | HAH2 | 71.4° | 60.0° |
| HAF1 | CAF | CAG | CAH | 76.1° | 60.0° |
| HAF1 | CAF | CAG | HAG1 | 164.4° | 179.9° |
| HAF1 | CAF | CAG | HAG2 | 44.0° | 60.0° |
| HAF2 | CAF | CAG | CAH | 45.1° | 60.1° |
| HAF2 | CAF | CAG | HAG1 | 74.5° | 60.0° |
| HAF2 | CAF | CAG | HAG2 | 165.1° | 179.9° |
| CAH | CAG | HAG1 | HAG2 | 119.7° | 120.0° |
| CAG | CAH | CAI | HAH1 | 120.3° | 120.1° |
| CAG | CAH | CAI | HAH2 | 120.0° | 120.0° |
| CAG | CAH | HAH1 | HAH2 | 120.2° | 119.9° |
| CAG | CAH | CAI | CAJ | 170.8° | 180.0° |
| CAG | CAH | CAI | HAI1 | 70.4° | 60.0° |
| CAG | CAH | CAI | HAI2 | 50.8° | 60.1° |
| HAG1 | CAG | CAH | CAI | 71.9° | 60.0° |
| HAG1 | CAG | CAH | HAH1 | 167.8° | 180.0° |
| HAG1 | CAG | CAH | HAH2 | 48.2° | 60.0° |
| HAG2 | CAG | CAH | CAI | 48.5° | 60.0° |
| HAG2 | CAG | CAH | HAH1 | 71.8° | 60.0° |
| HAG2 | CAG | CAH | HAH2 | 168.6° | 180.0° |
| CAI | CAH | HAH1 | HAH2 | 120.3° | 120.0° |
| CAH | CAI | CAJ | HAI1 | 118.8° | 120.0° |
| CAH | CAI | CAJ | HAI2 | 120.0° | 119.9° |
| CAH | CAI | HAI1 | HAI2 | 119.2° | 120.0° |
| CAH | CAI | CAJ | CAK | 163.2° | 180.0° |
| CAH | CAI | CAJ | HAJ1 | 77.0° | 59.9° |
| CAH | CAI | CAJ | HAJ2 | 43.2° | 60.0° |
| HAH1 | CAH | CAI | CAJ | 50.5° | 59.9° |
| HAH1 | CAH | CAI | HAI1 | 169.3° | 180.0° |
| HAH1 | CAH | CAI | HAI2 | 69.5° | 60.0° |
| HAH2 | CAH | CAI | CAJ | 69.2° | 60.0° |
| HAH2 | CAH | CAI | HAI1 | 49.6° | 60.0° |
| HAH2 | CAH | CAI | HAI2 | 170.8° | 180.0° |
| CAJ | CAI | HAI1 | HAI2 | 119.3° | 120.0° |
| CAI | CAJ | CAK | HAJ1 | 119.8° | 120.1° |
| CAI | CAJ | CAK | HAJ2 | 120.0° | 120.0° |
| CAI | CAJ | HAJ1 | HAJ2 | 119.9° | 119.9° |
| CAI | CAJ | CAK | CAL | 71.6° | 180.0° |
| CAI | CAJ | CAK | HAK1 | 169.7° | 60.0° |
| CAI | CAJ | CAK | HAK2 | 48.3° | 60.0° |
| HAI1 | CAI | CAJ | CAK | 44.4° | 60.0° |
| HAI1 | CAI | CAJ | HAJ1 | 164.2° | 180.0° |
| HAI1 | CAI | CAJ | HAJ2 | 75.6° | 60.0° |
| HAI2 | CAI | CAJ | CAK | 76.8° | 60.1° |
| HAI2 | CAI | CAJ | HAJ1 | 43.0° | 60.0° |
| HAI2 | CAI | CAJ | HAJ2 | 163.2° | 180.0° |
| CAK | CAJ | HAJ1 | HAJ2 | 119.9° | 120.0° |
| CAJ | CAK | CAL | HAK1 | 118.7° | 120.0° |
| CAJ | CAK | CAL | HAK2 | 120.0° | 119.9° |
| CAJ | CAK | HAK1 | HAK2 | 119.2° | 119.9° |
| CAJ | CAK | CAL | CAM | 136.6° | 180.0° |
| CAJ | CAK | CAL | HAL1 | 105.1° | 59.9° |
| CAJ | CAK | CAL | HAL2 | 16.6° | 60.0° |
| HAJ1 | CAJ | CAK | CAL | 48.2° | 59.9° |
| HAJ1 | CAJ | CAK | HAK1 | 70.5° | 180.0° |
| HAJ1 | CAJ | CAK | HAK2 | 168.1° | 60.0° |
| HAJ2 | CAJ | CAK | CAL | 168.4° | 60.0° |
| HAJ2 | CAJ | CAK | HAK1 | 49.7° | 60.0° |
| HAJ2 | CAJ | CAK | HAK2 | 71.7° | 180.0° |
| CAL | CAK | HAK1 | HAK2 | 119.2° | 120.0° |
| CAK | CAL | CAM | HAL1 | 118.4° | 120.1° |
| CAK | CAL | CAM | HAL2 | 120.0° | 120.0° |
| CAK | CAL | HAL1 | HAL2 | 119.0° | 119.9° |
| CAK | CAL | CAM | OAC | 142.4° | 180.0° |
| CAK | CAL | CAM | OAB | 36.2° | 0.1° |
| HAK1 | CAK | CAL | CAM | 17.9° | 60.0° |
| HAK1 | CAK | CAL | HAL1 | 136.3° | 179.9° |
| HAK1 | CAK | CAL | HAL2 | 102.1° | 60.0° |
| HAK2 | CAK | CAL | CAM | 103.4° | 60.1° |
| HAK2 | CAK | CAL | HAL1 | 14.9° | 60.0° |
| HAK2 | CAK | CAL | HAL2 | 136.6° | 180.0° |
| CAM | CAL | HAL1 | HAL2 | 119.0° | 120.0° |
| CAL | CAM | OAC | OAB | 178.7° | 179.9° |
| CAL | CAM | OAC | HAC | 178.7° | 180.0° |
| HAL1 | CAL | CAM | OAC | 99.2° | 59.9° |
| HAL1 | CAL | CAM | OAB | 82.2° | 120.0° |
| HAL2 | CAL | CAM | OAC | 22.4° | 60.0° |
| HAL2 | CAL | CAM | OAB | 156.2° | 120.0° |
| OAB | CAM | OAC | HAC | 0.0° | 0.1° |
